N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-(4-chlorophenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(4-chlorophenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-(4-chlorophenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C22H18ClN5O2S2 MolecularWeight: 483.99362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CN(N=C2C3=CC=C(C=C3)Cl)C4=CC=CC=C4)SCC(=O)N

InChI

InChI=1S/C22H18ClN5O2S2/c1-13-21(31-12-18(24)29)32-22(25-13)26-20(30)17-11-28(16-5-3-2-4-6-16)27-19(17)14-7-9-15(23)10-8-14/h2-11H,12H2,1H3,(H2,24,29)(H,25,26,30)